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4,5,6,7-Tetrahydro-2-methyl-2,4-diphenyl-4,7a,12b-triazadibenzo[e,g]azulene-1,3,8-trione
SpectraBase Compound ID 9zIazUshJwK
InChI InChI=1S/C28H23N3O3/c1-28(19-11-4-2-5-12-19)26(33)30(20-13-6-3-7-14-20)24-23-17-10-18-29(23)25(32)21-15-8-9-16-22(21)31(24)27(28)34/h2-9,11-16H,10,17-18H2,1H3
InChIKey HTXVMKGIIMPNNK-UHFFFAOYSA-N
Mol Weight 449.51 g/mol
Molecular Formula C28H23N3O3
Exact Mass 449.173942 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1dpxdvUEYg9
Name 4,5,6,7-TETRAHYDRO-2-METHYL-2,4-DIPHENYL-4,7A,12B-TRIAZADIBENZO-[E,G]-AZULENE-1,3,8-TRIONE
Compound Number 17
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H23N3O3
InChI InChI=1S/C28H23N3O3/c1-28(19-11-4-2-5-12-19)26(33)30(20-13-6-3-7-14-20)24-23-17-10-18-29(23)25(32)21-15-8-9-16-22(21)31(24)27(28)34/h2-9,11-16H,10,17-18H2,1H3
InChIKey HTXVMKGIIMPNNK-UHFFFAOYSA-N
Literature Reference Author A.SCHMIDT,A.G.SHILABIN,J.C.NAMYSLO,M.NIEGER,S.HEMMEN
Literature Reference Citation EUR.J.ORG.CHEM.,1781(2005)
Literature Reference DOI 10.1002/ejoc.200400738
Molecular Weight 449.509 g/mol
Sample ID 39110
Solvent DMSO-D6